Basic information
- CAS
5831-77-6- Standard SMILES
C=CCOc1ccccn1- InChIKey
LVLLWFVQZIHMFA-UHFFFAOYSA-N- Molecular formula
- C8H9NO
- Average molar mass
- 135.16 g/mol
- Monoisotopic mass
- 135.06841391
Names & identifiers
- Preferred name
- Allyl 2-pyridyl ether
- IUPAC
- 2-prop-2-enoxypyridine
- English name
- 2-Allyloxypyridine
- Molecular formula
- C8H9NO
- Molecular weight
- 135.16
Names & synonyms
Allyl 2-pyridyl etherEINECS 227-409-9DTXSID10207043NSC 76542RefChem:554827DTXCID10129534227-409-92-ALLYLOXYPYRIDINE5831-77-62-prop-2-enoxypyridine2-(ALLYLOXY)PYRIDINENSC-76542
Show more names
2-(2-Propenyloxy)pyridine2-(2-propen-1-yloxy)-PyridinePyridine, 2-(2-propen-1-yloxy)-
2-(prop-2-en-1-yloxy)pyridineNSC765422-prop-2-enyloxypyridineSCHEMBL360993S5EBL662N8SCHEMBL32601512-(2-Propen-1-yloxy)pyridineSCHEMBL10638072
Database identifiers
- CAS
5831-77-6- PubChem CID
- 79906
- DTXSID
DTXSID10207043- UNII
- S5EBL662N8
- EC Number
- 227-409-9
- Nikkaji
- J218.086C
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 103
Physicochemical properties
- Boiling point
- 30 · 30-35 °C(Press: 1.5 Torr)
- Density
- 1.0234 g/cm3 · 1.0234 g/cm3
- pka
- 4.41 · 4.41±0.19(Predicted)
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 315 · H315-H318-H335-H301
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P310-P321-P330-P405-P501
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 26 · 26-36/37/39
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- risk_code
- 20/21/22-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- safety_code
- 26-36/37/39
- Hazard statements
- H315-H318-H335-H301
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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